REMARK VINA RESULT: -7.6 1.974 5.961 REMARK 4 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_14 REMARK 2 A between atoms: O_2 and C_15 REMARK 3 A between atoms: C_3 and C_4 REMARK 4 A between atoms: C_3 and C_5 ROOT ATOM 1 C UNL d 1 4.011 3.967 3.357 0.00 0.00 0.077 C ENDROOT BRANCH 1 2 ATOM 2 C UNL d 1 3.033 4.855 4.100 0.00 0.00 -0.054 A ATOM 3 C UNL d 1 3.314 5.307 5.398 0.00 0.00 0.010 A ATOM 4 C UNL d 1 2.387 6.084 6.102 0.00 0.00 0.037 A ATOM 5 C UNL d 1 1.172 6.403 5.507 0.00 0.00 0.065 A ATOM 6 C UNL d 1 0.878 5.977 4.220 0.00 0.00 0.037 A ATOM 7 C UNL d 1 1.806 5.208 3.514 0.00 0.00 0.010 A BRANCH 5 8 ATOM 8 O UNL d 1 0.230 7.139 6.162 0.00 0.00 -0.361 OA ATOM 9 H UNL d 1 0.671 7.667 6.849 0.00 0.00 0.217 HD ENDBRANCH 5 8 ENDBRANCH 1 2 BRANCH 1 10 ATOM 10 C UNL d 1 5.200 3.554 4.197 0.00 0.00 -0.054 A ATOM 11 C UNL d 1 6.389 4.300 4.166 0.00 0.00 0.010 A ATOM 12 C UNL d 1 7.520 3.870 4.867 0.00 0.00 0.037 A ATOM 13 C UNL d 1 7.461 2.698 5.612 0.00 0.00 0.065 A ATOM 14 C UNL d 1 6.281 1.967 5.691 0.00 0.00 0.037 A ATOM 15 C UNL d 1 5.155 2.390 4.981 0.00 0.00 0.010 A BRANCH 13 16 ATOM 16 O UNL d 1 8.550 2.229 6.286 0.00 0.00 -0.361 OA ATOM 17 H UNL d 1 8.511 2.564 7.197 0.00 0.00 0.217 HD ENDBRANCH 13 16 ENDBRANCH 1 10 TORSDOF 4